O1-methyl O3-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[2-(1-naphthylamino)-2-oxo-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-(1-naphthalenylamino)-2-oxoethyl] ester IUPAC Name: 1-O-methyl 3-O-[2-(naphthalen-1-ylamino)-2-oxoethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-keto-2-(1-naphthylamino)ethyl] ester O1-methyl ester Formula: C21H16N2O7 MolecularWeight: 408.36094

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H16N2O7/c1-29-20(25)14-9-15(11-16(10-14)23(27)28)21(26)30-12-19(24)22-18-8-4-6-13-5-2-3-7-17(13)18/h2-11H,12H2,1H3,(H,22,24)